pyoptking
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Contents:
Getting Started
Convergence
Optimization Algorithms
API Documentation
optking.stepAlgorithms Module
optking.linesearch Module
optking.IRCfollowing Module
Functions
irc_de_projected
step_n_factor
Classes
Class Inheritance Diagram
The Molecular System
General Recommendations
Adding Constraints to the Optimization
Multifragment Optimizations
Keywords and Options
pyoptking
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Optimization Algorithms
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step_n_factor
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step_n_factor
optking.IRCfollowing.
step_n_factor
(
G
,
g
)
[source]
Computes distance scaling factor for mass-weighted internals.
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